LMFA07010653
  LIPID_MAPS_STRUCTURE_DATABASE

 13 12  0  0  0  0  0  0  0  0999 V2000
    9.9969    7.5909    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9969    6.9365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6512    6.4252    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2831    6.5564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5693    6.9762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8554    6.5564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1415    6.9762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4277    6.5564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7138    6.9762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.5564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9375    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6512    5.4704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3684    5.0563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3 12  1  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 12 11  1  0  0  0  0
 12 13  1  0  0  0  0
M  END
> <LM_ID>
LMFA07010653

> <COMMON_NAME>
Isopropyl octanoate 

> <SYSTEMATIC_NAME>
Isopropyl octanoate 

> <FORMULA>
C11H22O2

> <MASS>
186.16

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Short fatty esters [FA0710]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
WE(/2:0(1Me)/8:0)

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
179389

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
21606

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMFA07010653

$$$$